SCHEMBL11604147

SCHEMBL11604147

O=C(O)c1cccc(C(O)C(O)c2ccccc2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 1/20 0.56
ENPEP Q07075 1/20 0.56
KMO O15229 1/20 0.52
CA1 P00915 2/20 0.50
CA2 P00918 2/20 0.50
CA9 Q16790 2/20 0.50
DAO P14920 1/20 0.50
TSHR P16473 1/20 0.50
NAPRT Q6XQN6 1/20 0.50
CA12 O43570 1/20 0.50
CA6 P23280 1/20 0.50
AKR1C3 P42330 1/20 0.48
LMNA P02545 2/20 0.48
CES2 O00748 1/20 0.48
CES1 P23141 1/20 0.48
MAPT P10636 2/20 0.47
PTGS1 P23219 2/20 0.47
CXCR1 P25024 2/20 0.47
CXCR2 P25025 2/20 0.47
PTGS2 P35354 2/20 0.47

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL4406176 0.96 ANPEP (0.59) ANPEPENPEPKMOCA1CA2
SCHEMBL11604512 0.96 ANPEP (0.59) ANPEPENPEPKMOCA1CA2
SCHEMBL4406179 0.96 ANPEP (0.59) ANPEPENPEPKMOCA1CA2
SCHEMBL1017863 0.86 ANPEP (0.54) ANPEPENPEPKMOCA1CA2
SCHEMBL3346923 0.84 CA1 (0.63) ANPEPENPEPKMOCA1CA2
SCHEMBL1237712 0.83 ANPEP (0.59) ANPEPENPEPKMOCA1CA2
SCHEMBL23581249 0.82 ANPEP (0.58) ANPEPENPEPKMOCA1CA2
SCHEMBL4430838 0.82 ANPEP (0.58) ANPEPENPEPKMOCA1CA2
SCHEMBL11606719 0.81 TSHR (0.56) ANPEPDAOTSHRNAPRTLMNA
SCHEMBL2957369 0.81 ANPEP (0.61) ANPEPENPEPKMOCA1CA2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4087463-A COBALT CARBONYL CATALYST MONSANTO COMPANY (US) 1978-05-02 US disclosed